N-(2-carbamimidoylphenyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]pyrrole-2-carboxamide

Systemtic Name: N-(2-carbamimidoylphenyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]pyrrole-2-carboxamide Openeye Name: N-(2-carbamimidoylphenyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxamide CAS Name: N-(2-carbamimidoylphenyl)-1-methyl-4-[[[1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]-2-pyrrolecarboxamide IUPAC Name: N-(2-carbamimidoylphenyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxamide Traditional Name: N-(2-amidinophenyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]pyrrole-2-carboxamide Formula: C25H25N9O5 MolecularWeight: 531.5233

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC=CC=C2C(=N)N)NC(=O)C3=CC(=CN3C)NC(=O)C4=CC(=CN4C)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC=CC=C2C(=N)N)NC(=O)C3=CC(=CN3C)NC(=O)C4=CC(=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C25H25N9O5/c1-31-11-14(29-24(36)21-10-16(34(38)39)13-33(21)3)8-19(31)23(35)28-15-9-20(32(2)12-15)25(37)30-18-7-5-4-6-17(18)22(26)27/h4-13H,1-3H3,(H3,26,27)(H,28,35)(H,29,36)(H,30,37)